N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-[(4-methoxyphenyl)thio]butyramide Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=CC(=C4S3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)SCCCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=CC(=C4S3)OC)OC

InChI

InChI=1S/C25H26N2O5S2/c1-29-17-8-10-19(11-9-17)33-15-5-7-22(28)27(16-18-6-4-14-32-18)25-26-23-20(30-2)12-13-21(31-3)24(23)34-25/h4,6,8-14H,5,7,15-16H2,1-3H3